Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5695680 | 1.00 | TSHR (0.46) | TSHRGPR139CYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL5695683 | 0.87 | SLC6A3 (0.47) | TSHRGPR139CYP1A2KMT2AMEN1 | |
| SCHEMBL5695679 | 0.87 | SLC6A3 (0.47) | TSHRGPR139CYP1A2KMT2AMEN1 | |
| SCHEMBL6162834 | 0.83 | GPR139 (0.46) | TSHRGPR139CYP1A2KMT2AALDH1A1 | |
| SCHEMBL10647041 | 0.81 | TSHR (0.68) | TSHRGPR139KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL6169492 | 0.81 | CYP1A2 (0.61) | CYP1A2SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL6209557 | 0.81 | CYP1A2 (0.61) | CYP1A2SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL9814713 | 0.80 | CPA3 (0.54) | TSHRGPR139CYP1A2ALDH1A1 | |
| SCHEMBL6576344 | 0.79 | CYP1A2 (0.44) | TSHRCYP1A2KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL6576342 | 0.79 | CYP1A2 (0.44) | TSHRCYP1A2KMT2ASMN1; SMN2MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0947502-B1 | NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES | SANTEN PHARMACEUTICAL CO LTD (JP) | 2006-06-21 | — | — | EP | disclosed |
| EP-0870762-B1 | NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP | SANTEN PHARMACEUTICAL CO LTD (JP) | 2004-04-28 | — | — | EP | disclosed |
| US-6046235-A | SULFUR-CONTAINING AMINO ACID DERIVATIVES WHICH HAVE INHIBITORY EFFECTS ON LEUKOTRIENE A4 HYDROLASE AND USEFUL AS THERAPEUTICAL AGENTS FOR INFLAMMATORY DISEASES SUCH AS RHEUMATISM, PSORIASIS, GOUT, CYSTIC FIBROSIS AND BOWL DISEASES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2000-04-04 | — | — | US | disclosed |
| EP-0947502-A1 | NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1999-10-06 | — | — | EP | disclosed |
| US-5872281-A | COMPOUNDS FOR TREATMENT OF RHEUMATIC DISEASES, PSORIASIS, INTESTINAL INFLAMATION | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1999-02-16 | — | — | US | disclosed |
| EP-0870762-A1 | NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1998-10-14 | — | — | EP | disclosed |
| EP-0259465-A1 | PROCESS FOR PREPARING OPTICALLY-ACTIVE 3-ACYLTHIO-2-METHYLPROPIONIC ACID DERIVATIVES | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1988-03-16 | — | — | EP | disclosed |
| WO-1987005328-A1 | PROCESS FOR PREPARING OPTICALLY-ACTIVE 3-ACYLTHIO-2-METHYLPROPIONIC ACID DERIVATIVES | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1987-09-11 | — | — | WO | disclosed |